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BorgwardtLab / proteinshake

Protein structure datasets for machine learning.
https://proteinshake.ai
BSD 3-Clause "New" or "Revised" License
99 stars 8 forks source link

use biopandas API for saving PDBs #149

Closed cgoliver closed 1 year ago

cgoliver commented 1 year ago

https://biopandas.github.io/biopandas/tutorials/Working_with_PDB_Structures_in_DataFrames/

timkucera commented 1 year ago

obsolete (we don't write pdbs anymore)